ethyl (3Z)-2-oxidanylidene-3-[phenyl-[[4-(propylaminomethyl)phenyl]amino]methylidene]-1H-indole-6-carboxylate

Systemtic Name: ethyl (3Z)-2-oxidanylidene-3-[phenyl-[[4-(propylaminomethyl)phenyl]amino]methylidene]-1H-indole-6-carboxylate Openeye Name: ethyl (3Z)-2-oxo-3-[phenyl-[4-(propylaminomethyl)anilino]methylene]indoline-6-carboxylate CAS Name: (3Z)-2-oxo-3-[phenyl-[4-(propylaminomethyl)anilino]methylidene]-1H-indole-6-carboxylic acid ethyl ester IUPAC Name: ethyl (3Z)-2-oxo-3-[phenyl-[4-(propylaminomethyl)anilino]methylidene]-1H-indole-6-carboxylate Traditional Name: (3Z)-2-keto-3-[phenyl-[4-(propylaminomethyl)anilino]methylene]indoline-6-carboxylic acid ethyl ester Formula: C28H29N3O3 MolecularWeight: 455.54816

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=CC=C(C=C1)NC(=C2C3=C(C=C(C=C3)C(=O)OCC)NC2=O)C4=CC=CC=C4

Isomeric SMILES

CCCNCC1=CC=C(C=C1)N/C(=C\2/C3=C(C=C(C=C3)C(=O)OCC)NC2=O)/C4=CC=CC=C4

InChI

InChI=1S/C28H29N3O3/c1-3-16-29-18-19-10-13-22(14-11-19)30-26(20-8-6-5-7-9-20)25-23-15-12-21(28(33)34-4-2)17-24(23)31-27(25)32/h5-15,17,29-30H,3-4,16,18H2,1-2H3,(H,31,32)/b26-25-